Crystallography Open Database

Information card for entry 7045541

Preview

Coordinates	7045541.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70.88 H74.65 B2 I1.12 O P4 Pt
Calculated formula	C70.884 H74.652 B2 I1.1159 O P4 Pt
Title of publication	Expanding the allyl analogy: accessing η<sup>3</sup>-P,B,P diphosphinoborane complexes of group 10.
Authors of publication	Drover, Marcus W.; Peters, Jonas C.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	11
Pages of publication	3733 - 3738
a	12.3295 ± 0.0006 Å
b	19.2099 ± 0.0009 Å
c	27.5709 ± 0.0013 Å
α	90°
β	94.522 ± 0.002°
γ	90°
Cell volume	6509.8 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0486
Residual factor for significantly intense reflections	0.0334
Weighted residual factors for significantly intense reflections	0.0722
Weighted residual factors for all reflections included in the refinement	0.0757
Goodness-of-fit parameter for all reflections included in the refinement	1.072
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
229987 (current)	2019-11-17	cif/ Updating files of 7045536, 7045537, 7045538, 7045539, 7045540, 7045541 Original log message: Adding full bibliography for 7045536--7045541.cif.	7045541.cif
206223	2018-02-06	cif/ Adding structures of 7045536, 7045537, 7045538, 7045539, 7045540, 7045541 via cif-deposit CGI script.	7045541.cif